2-Butanone, 3-methyl-4-(methylthio)- (7CI,9CI)
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2-Butanone, 3-methyl-4-(methylthio)- (7CI,9CI)
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CAS No:
89534-16-7
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Formula:
C6H12OS
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Chemical Name:
2-Butanone, 3-methyl-4-(methylthio)- (7CI,9CI)
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Synonyms:
3-methyl-5-thiahexan-2-one;SCHEMBL859062;3-Methyl-5-thiahexane-2-one;4-methylthio-3-methylbutan-2-one;3-methyl-4-methylsulfanylbutan-2-one
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CAS No:
Computed Properties
Molecular Weight:132.23
XLogP3:1.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:132.06088618
Monoisotopic Mass:132.06088618
Topological Polar Surface Area:42.4
Heavy Atom Count:8
Complexity:80.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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